Arteannuin M

CAT: 0926-HIA44690-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0926-HIA44690-01Size:5 mg

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CAS Number

207446-90-0

MDL Number

MFCD20274812

Smiles

CC1CCC2C (C (=O) OC23C1CCC (C3O) (C) O) C

Molecular Formula

C15H24O4

Molecular Weight

268.35 g/mol

Controlled

Chemical Information

Arteannuin M

(3R,3aS,6R,6aS,9R,10R,10aS)-9,10-dihydroxy-3,6,9-trimethyl-octahydro-3H-naphtho[4a,4-b]furan-2-one has been reported in Artemisia annua with data available.

CAS Number	207446-90-0
PubChem CID	21593315
IUPAC Name	(3R,3aS,6R,6aS,9R,10R,10aS)-9,10-dihydroxy-3,6,9-trimethyl-3a,4,5,6,6a,7,8,10-octahydro-3H-benzo[h][1]benzofuran-2-one
Molecular Formula	C15H24O4
Molecular Weight	268.35
XLogP	1.7
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Heavy Atom Count	19
Formal Charge	0
Complexity	409

SMILES

C[C@@H]1CC[C@H]2[C@H](C(=O)O[C@@]23[C@H]1CC[C@@]([C@H]3O)(C)O)C

InChI

InChI=1S/C15H24O4/c1-8-4-5-11-9(2)12(16)19-15(11)10(8)6-7-14(3,18)13(15)17/h8-11,13,17-18H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15+/m1/s1

InChIKey

FONFQQKKCDVNRC-GZEPNZDPSA-N

Chemical Structure

2D Structure

CAS: 207446-90-0

CID: 21593315

Formula: C15H24O4

MW: 268.35

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	268.35
XLogP3	1.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	268.16745924
Monoisotopic Mass	268.16745924
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	409
Isotope Atom Count	0
Defined Atom Stereocenter Count	7
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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GTR19182041	Arteannuin A
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379625	Arteannuin M
379624	Arteannuin L
AR-A02594-01	Arteannuin H
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